SCHEMBL13701684

SCHEMBL13701684

CC(C)(C)NC(=O)c1cccc(-c2ccccc2C(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BCAT2 O15382 1/20 0.51
▸ MAPT P10636 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ALOX5AP P20292 1/20 0.46
▸ FEN1 P39748 1/20 0.46
▸ PLA2G2A P14555 1/20 0.44
▸ F10 P00742 2/20 0.44
▸ PRSS1 P07477 2/20 0.44
▸ PRSS2 P07478 2/20 0.44
▸ PRSS3 P35030 2/20 0.44
▸ LMNA P02545 2/20 0.43
▸ NR1H4 Q96RI1 1/20 0.41
▸ PDK2 Q15119 2/20 0.41
▸ S100B P04271 1/20 0.41
▸ ANO1 Q5XXA6 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13701672 0.83 PLAU (0.48) LMNAS100BHDAC8
SCHEMBL13611931 0.82 NR1H4 (0.60) MAPTMEN1KMT2ALMNANR1H4
SCHEMBL13701644 0.82 ANO1 (0.52) MAPTMEN1KMT2ALMNANR1H4
SCHEMBL13702261 0.81 BCAT2 (0.51) BCAT2PLA2G2AF10PRSS1PRSS2
SCHEMBL28096188 0.81 BCAT2 (0.67) BCAT2MAPTPLA2G2APDK2
SCHEMBL13701695 0.79 HDAC8 (0.64) MAPTFEN1LMNANR1H4S100B
SCHEMBL13701638 0.79 PLAU (0.51) MAPTKMT2ALMNAHDAC8
SCHEMBL7606412 0.78 L3MBTL1 (0.64) MEN1KMT2ALMNANR1H4ANO1
SCHEMBL3043951 0.78 PARP1 (0.52) KMT2ALMNAS100BANO1
SCHEMBL10908563 0.77 BCAT2 (0.77) BCAT2MAPTALOX5APFEN1PLA2G2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 — — US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors EPHX1, EPHX2, EPX BCAT2 3651/4885MAPT 4084/4885MEN1 4409/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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